Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:41:30 UTC
Update Date2025-03-21 21:55:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00441682
Frequency4.0
Structure
Chemical FormulaC7H12O2
Molecular Mass128.0837
SMILESCC=CC(=O)COCC
InChI KeySDHLUBOUNWRLIJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass acryloyl compounds
Direct Parent acryloyl compounds
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • dialkyl ethers
  • enones
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • ether
  • alpha,beta-unsaturated ketone
  • dialkyl ether
  • ketone
  • organic oxide
  • hydrocarbon derivative
  • acryloyl-group
  • enone